mp_ID stringlengths 4 10 | x float64 -10.28 17.7 | y float64 -12.01 23.9 | z float64 -8.99 7.96 | type stringclasses 2
values | formula stringlengths 2 26 | n_atoms int64 1 444 | spacegroup int64 1 230 | volume float64 5.61 20.1k |
|---|---|---|---|---|---|---|---|---|
mp-554889 | -4.841758 | -1.744958 | -6.706078 | other | Zn24S24 | 48 | 156 | 939.39 |
mp-680112 | -1.191703 | 2.836784 | -3.003072 | other | Cd11I22 | 33 | 156 | 1,323.33 |
mp-567178 | -0.938486 | 2.346817 | -3.015444 | other | Pb3I6 | 9 | 156 | 407.33 |
mp-624307 | -6.271903 | -2.765536 | -2.302376 | other | Cu14Te8 | 22 | 156 | 407.45 |
mp-554115 | -4.840446 | -1.74439 | -6.703028 | other | Zn24S24 | 48 | 156 | 939.63 |
mp-1100827 | -4.514982 | -2.71903 | 1.992683 | other | Zr40S27 | 67 | 156 | 1,369.35 |
mp-770433 | -7.819452 | -7.453396 | 1.892635 | other | Ag11Hg9 | 20 | 156 | 419.49 |
mp-571298 | -1.157712 | 0.552493 | 2.364927 | other | Si39C39 | 78 | 156 | 802.63 |
mp-556732 | -4.841338 | -1.742722 | -6.703374 | other | Zn20S20 | 40 | 156 | 781.73 |
mp-571567 | -1.207906 | 2.842432 | -3.005887 | other | Cd8I16 | 24 | 156 | 912.4 |
mp-1094620 | -6.681906 | -9.524797 | 4.867134 | other | Mg3Ga3 | 6 | 156 | 122 |
mp-571559 | -1.208052 | 2.842418 | -3.005691 | other | Cd10I20 | 30 | 156 | 1,140.87 |
mp-680087 | -4.840035 | -1.782197 | -6.724952 | other | Zn44S44 | 88 | 156 | 1,781.11 |
mp-1094327 | -4.93119 | -7.522989 | 3.725713 | other | Sr3Mg3 | 6 | 156 | 241.4 |
mp-1203179 | -0.93821 | 2.348967 | -3.022867 | other | Pb12I24 | 36 | 156 | 1,631.06 |
mp-581425 | -4.839992 | -1.781785 | -6.724891 | other | Zn36S36 | 72 | 156 | 1,456.58 |
mp-554961 | -4.840864 | -1.743823 | -6.703373 | other | Zn28S28 | 56 | 156 | 1,095.55 |
mp-1120762 | -4.043345 | -1.541117 | -5.538814 | other | Cd2S1 | 3 | 156 | 79 |
mp-570127 | -1.208506 | 2.843309 | -3.005667 | other | Cd8I16 | 24 | 156 | 909.57 |
mp-680146 | -1.193221 | 2.837441 | -3.002936 | other | Cd19I38 | 57 | 156 | 2,280.36 |
mp-624406 | -1.208514 | 2.843208 | -3.005561 | other | Cd10I20 | 30 | 156 | 1,136.93 |
mp-571668 | -1.193114 | 2.840536 | -3.004137 | other | Cd12I24 | 36 | 156 | 1,458.89 |
mp-556775 | -4.842126 | -1.74411 | -6.706098 | other | Zn16S16 | 32 | 156 | 625.75 |
mp-624417 | -1.191781 | 2.836831 | -3.003073 | other | Cd11I22 | 33 | 156 | 1,323.19 |
mp-680047 | -1.193267 | 2.838409 | -3.003026 | other | Cd14I28 | 42 | 156 | 1,684.6 |
mp-1356781 | 6.085237 | 13.165612 | -2.564915 | other | Co12O24 | 36 | 156 | 387.29 |
mp-556207 | -4.841784 | -1.743511 | -6.704906 | other | Zn20S20 | 40 | 156 | 782 |
mp-582680 | -4.840256 | -1.78159 | -6.725316 | other | Zn36S36 | 72 | 156 | 1,456.11 |
mp-1038862 | -5.847932 | -9.43576 | 4.980617 | other | Ca3Mg3 | 6 | 156 | 196.18 |
mp-568696 | -1.155956 | 0.563237 | 2.359821 | other | Si14C14 | 28 | 156 | 288.81 |
mp-1227691 | -5.469644 | -1.490234 | 4.764661 | other | Be46Os7 | 53 | 156 | 499.63 |
mp-570314 | -1.208469 | 2.843092 | -3.005553 | other | Cd9I18 | 27 | 156 | 1,023.21 |
mp-571091 | -1.207674 | 2.841437 | -3.006119 | other | Cd7I14 | 21 | 156 | 804.5 |
mp-684977 | 11.606238 | 9.688466 | 3.273757 | other | Zr27O49 | 76 | 156 | 919.1 |
mp-680055 | -1.191848 | 2.836888 | -3.003081 | other | Cd11I22 | 33 | 156 | 1,323.06 |
mp-680111 | -1.207513 | 2.840629 | -3.006121 | other | Cd4I8 | 12 | 156 | 460.73 |
mp-557062 | -4.841619 | -1.744708 | -6.705624 | other | Zn20S20 | 40 | 156 | 782.71 |
mp-1359404 | 6.060758 | 13.200774 | -2.587878 | other | Co12O24 | 36 | 156 | 388.11 |
mp-570492 | -1.208586 | 2.843013 | -3.005743 | other | Cd13I26 | 39 | 156 | 1,470.26 |
mp-571646 | -1.193805 | 2.84028 | -3.003925 | other | Cd12I24 | 36 | 156 | 1,453.84 |
mp-569510 | -1.191687 | 2.841866 | -3.004626 | other | Cd16I32 | 48 | 156 | 1,963.59 |
mp-570939 | -1.2076 | 2.840683 | -3.0061 | other | Cd6I12 | 18 | 156 | 691.46 |
mp-680163 | -1.196125 | 2.839618 | -3.00288 | other | Cd25I50 | 75 | 156 | 2,997.22 |
mp-570671 | -1.207605 | 2.841138 | -3.006251 | other | Cd6I12 | 18 | 156 | 690.85 |
mp-624418 | -1.191689 | 2.836888 | -3.003065 | other | Cd11I22 | 33 | 156 | 1,323.59 |
mp-569666 | -1.189095 | 2.843864 | -3.005222 | other | Cd17I34 | 51 | 156 | 2,123.47 |
mp-680085 | -4.839617 | -1.781866 | -6.724286 | other | Zn44S44 | 88 | 156 | 1,780.66 |
mp-571286 | -1.15797 | 0.557378 | 2.364081 | other | Si36C36 | 72 | 156 | 740.86 |
mp-570410 | -1.20755 | 2.840846 | -3.006591 | other | Cd9I18 | 27 | 156 | 1,039.99 |
mp-684907 | 11.787189 | 8.573874 | 1.934587 | other | U12O19 | 31 | 156 | 475.34 |
mp-556989 | -4.84164 | -1.745903 | -6.706683 | other | Zn18S18 | 36 | 156 | 705.03 |
mp-555381 | -4.841166 | -1.742643 | -6.702976 | other | Zn24S24 | 48 | 156 | 938.1 |
mp-556280 | -4.841304 | -1.742956 | -6.703498 | other | Zn20S20 | 40 | 156 | 781.88 |
mp-554004 | -4.841801 | -1.745601 | -6.706719 | other | Zn28S28 | 56 | 156 | 1,096.42 |
mp-556716 | -4.842395 | -1.744419 | -6.706946 | other | Zn14S14 | 28 | 156 | 547.54 |
mp-571592 | -1.207926 | 2.842466 | -3.005814 | other | Cd8I16 | 24 | 156 | 912.16 |
mp-556005 | -4.842929 | -1.743296 | -6.707011 | other | Zn8S8 | 16 | 156 | 312.56 |
mp-557308 | -4.841228 | -1.743528 | -6.703842 | other | Zn10S10 | 20 | 156 | 391.11 |
mp-1224879 | -3.906059 | -1.49162 | -5.841743 | other | Ga4S6 | 10 | 156 | 248.81 |
mp-1094592 | -6.246579 | -9.348433 | 4.471517 | other | Li3Mg3 | 6 | 156 | 127.45 |
mp-571654 | -1.208121 | 2.842913 | -3.005886 | other | Cd12I24 | 36 | 156 | 1,364.15 |
mp-557026 | -4.841413 | -1.743067 | -6.703798 | other | Zn18S18 | 36 | 156 | 703.71 |
mp-557346 | -4.841406 | -1.743133 | -6.703848 | other | Zn18S18 | 36 | 156 | 703.74 |
mp-669360 | -1.208497 | 2.843163 | -3.005532 | other | Cd12I24 | 36 | 156 | 1,364.56 |
mp-1096929 | -4.042436 | -0.776751 | -4.224576 | other | Zr64S127 | 191 | 156 | 5,069.99 |
mp-571635 | -1.184743 | 2.848818 | -3.00589 | other | Cd12I24 | 36 | 156 | 1,576.01 |
mp-556784 | -4.84076 | -1.742497 | -6.702051 | other | Zn22S22 | 44 | 156 | 860.02 |
mp-680172 | -1.194776 | 2.838422 | -3.002846 | other | Cd22I44 | 66 | 156 | 2,636.49 |
mp-568619 | -1.155247 | 0.556211 | 2.360891 | other | Si5C5 | 10 | 156 | 103.15 |
mp-568656 | -1.155817 | 0.555782 | 2.361299 | other | Si10C10 | 20 | 156 | 206.29 |
mp-581405 | -4.8404 | -1.782206 | -6.725546 | other | Zn40S40 | 80 | 156 | 1,619.01 |
mp-624399 | -1.208625 | 2.843177 | -3.005375 | other | Cd9I18 | 27 | 156 | 1,022.63 |
mp-568735 | -1.155782 | 0.552835 | 2.361904 | other | Si18C18 | 36 | 156 | 371.31 |
mp-567199 | -0.938171 | 2.348568 | -3.022301 | other | Pb5I10 | 15 | 156 | 680.15 |
mp-555594 | -4.841143 | -1.742762 | -6.70302 | other | Zn24S24 | 48 | 156 | 938.2 |
mp-554503 | -4.840736 | -1.744717 | -6.703875 | other | Zn28S28 | 56 | 156 | 1,096.33 |
mp-570559 | -1.207518 | 2.840505 | -3.006922 | other | Cd5I10 | 15 | 156 | 580.02 |
mp-570019 | -1.2077 | 2.841738 | -3.006113 | other | Cd8I16 | 24 | 156 | 918.44 |
mp-571569 | -1.208509 | 2.842864 | -3.005302 | other | Cd9I18 | 27 | 156 | 1,024.26 |
mp-684029 | -1.193782 | 2.838354 | -3.002979 | other | Cd14I28 | 42 | 156 | 1,682.03 |
mp-680113 | -1.191545 | 2.837058 | -3.003079 | other | Cd11I22 | 33 | 156 | 1,324.26 |
mp-570472 | -1.207976 | 2.842204 | -3.005658 | other | Cd5I10 | 15 | 156 | 571.56 |
mp-669326 | -1.207967 | 2.842706 | -3.005917 | other | Cd9I18 | 27 | 156 | 1,024.59 |
mp-571667 | -1.190272 | 2.842861 | -3.005092 | other | Cd13I26 | 39 | 156 | 1,611.08 |
mp-1094429 | -7.989478 | -9.73563 | 4.426534 | other | Mg3Zn3 | 6 | 156 | 114.47 |
mp-680145 | -1.193646 | 2.837091 | -3.002915 | other | Cd20I40 | 60 | 156 | 2,396.93 |
mp-555664 | -4.840762 | -1.742158 | -6.701768 | other | Zn24S24 | 48 | 156 | 937.98 |
mp-556448 | -4.840841 | -1.742724 | -6.702394 | other | Zn18S18 | 36 | 156 | 703.74 |
mp-570082 | -1.208059 | 2.842595 | -3.005757 | other | Cd8I16 | 24 | 156 | 911.41 |
mp-1021511 | -3.996015 | -1.415745 | -5.655318 | other | Cd1S1 | 2 | 156 | 92.89 |
mp-567246 | -0.938909 | 2.349305 | -3.020833 | other | Pb7I14 | 21 | 156 | 945.36 |
mp-555773 | -4.841386 | -1.743296 | -6.703952 | other | Zn18S18 | 36 | 156 | 703.82 |
mp-680205 | -0.935456 | 2.359271 | -3.069923 | other | Pb15I30 | 45 | 156 | 2,060.86 |
mp-555311 | -4.841211 | -1.744765 | -6.704854 | other | Zn26S26 | 52 | 156 | 1,017.8 |
mp-555151 | -4.840838 | -1.744001 | -6.70347 | other | Zn28S28 | 56 | 156 | 1,095.71 |
mp-1039136 | -7.037698 | -7.968776 | 2.943047 | other | Mg3Cd3 | 6 | 156 | 134.15 |
mp-570882 | -1.208425 | 2.843178 | -3.005877 | other | Cd6I12 | 18 | 156 | 679.29 |
mp-1101100 | -1.642269 | -8.14613 | 1.857592 | other | Ti3S4 | 7 | 156 | 884.98 |
mp-556363 | -4.841402 | -1.743166 | -6.703873 | other | Zn18S18 | 36 | 156 | 703.75 |
mp-557175 | -4.841423 | -1.742994 | -6.703764 | other | Zn18S18 | 36 | 156 | 703.66 |
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